CAS RN: 96960-92-8
1-O-HEXADECYL-2-O-METHYL-SN-GLYCEROL
Product Availability
Choose a grade to view its available package options.
1 package records0 with current stock1 grade group
| Batch No. | Package | Availability | Lead Time | Inquiry |
|---|---|---|---|---|
| Batchno.20250104 | 10mg | Out of stock | 5-7 business days | Inquiry |
- Product code: starshine_CAS96960-92-8
- Purity/Analytical Methods: >99.0%
96960-92-8 / 3-hexadecoxy-2-methoxypropan-1-ol
Basic Information
CAS
96960-92-8
Multi CAS
Yes
Molecular Formula
C20H42O3
Molecular Weight
330.500000
Exact Mass
330.313395
InChI
InChI=1S/C20H42O3/c1-3-4-5-6-7-8-9-10-11-12-13-14-15-16-17-23-19-20(18-21)22-2/h20-21H,3-19H2,1-2H3
InChIKey
XAWCMDFDFNRKGK-UHFFFAOYSA-N
Computed Properties
Structural Parameters
Heavy atom count
23
Fraction Csp3
1
Rotatable bonds
19
H-bond acceptors
3
H-bond donors
1
Molar refractivity
99.01
TPSA
38.69
LogP / Solubility
WLOGP
5.49
MLOGP
4.85
XLogP3
7.1
Consensus LogP
5.81
Log S (ESOL)
-4.1
Class (ESOL)
Slightly soluble
Log S (Ali)
-6.24
Class (Ali)
Insoluble
Log S (SILICOS-IT)
-8.65
Class (SILICOS-IT)
Insoluble
ADME
GI absorption
High
BBB permeant
No
P-gp substrate
No
CYP1A2 inhibitor
No
CYP2C19 inhibitor
No
CYP2C9 inhibitor
Yes
CYP2D6 inhibitor
No
CYP3A4 inhibitor
No
Log Kp (skin permeation)
-0.84
Drug-likeness / Medicinal Chemistry
Lipinski
Yes
Ghose
Yes
Veber
No
Egan
Yes
Muegge
No
Bioavailability score
0.55
Brenk alerts
1
Leadlikeness
No
Synthetic Accessibility
3
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